Brief Information of the Compound and Protein
Compound Name
methyl 4-[2-(3,4-dichlorophenyl)acetyl]-5-(3-hydroxypyrrolidin-1-yl)-2,3,4a,5,6,7,8,8a-octahydroquinoxaline-1-carboxylate
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PubChem ID
CID: 118710805
Canonical SMILES
COC(=O)N1CCN(C2C(CCCC12)N1CCC(O)C1)C(=O)Cc1ccc(Cl)c(Cl)c1
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Compound Formula C22H29Cl2N3O4
Compound Structure
Protein Name
Kappa-type opioid receptor
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Peptide receptor (family A GPCR)
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Short peptide receptor (family A GPCR)
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Opioid receptor
Uniprot ID
P41145
Gene Name
OPRK1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  2
1
EC50 = 79 nM
   TI
   LI
   LO
   TS
2
EC50 = 85 nM
   TI
   LI
   LO
   TS